COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.390  -1.266   2.042  1.00  0.00           O  
HETATM    2  O   UNL     1       6.238  -1.443   4.063  1.00  0.00           O  
HETATM    3  O   UNL     1       8.048   0.378   5.240  1.00  0.00           O  
HETATM    4  O   UNL     1       0.290  -2.708   5.063  1.00  0.00           O  
HETATM    5  O   UNL     1      -0.861  -1.522   3.451  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.748  -7.504   3.731  1.00  0.00           O  
HETATM    7  O   UNL     1      -0.883  -6.190   5.388  1.00  0.00           O  
HETATM    8  O   UNL     1       3.862  -3.563   2.249  1.00  0.00           O  
HETATM    9  O   UNL     1       3.437  -6.547   2.637  1.00  0.00           O  
HETATM   10  O   UNL     1       2.427  -0.662   2.206  1.00  0.00           O  
HETATM   11  O   UNL     1       2.456   1.718   0.571  1.00  0.00           O  
HETATM   12  O   UNL     1       2.199   0.906  -2.095  1.00  0.00           O  
HETATM   13  O   UNL     1       1.317  -1.668   0.368  1.00  0.00           O  
HETATM   14  N   UNL     1      10.717   0.414   3.938  1.00  0.00           N  
HETATM   15  N   UNL     1       0.227  -6.282   3.446  1.00  0.00           N  
HETATM   16  N   UNL     1       1.149  -4.594  -2.512  1.00  0.00           N  
HETATM   17  N   UNL     1       2.266  -4.903  -4.389  1.00  0.00           N  
HETATM   18  N   UNL     1      -1.641  -5.675  -7.230  1.00  0.00           N  
HETATM   19  C   UNL     1       0.086  -1.656   4.215  1.00  0.00           C  
HETATM   20  C   UNL     1       1.253  -0.683   4.337  1.00  0.00           C  
HETATM   21  C   UNL     1       0.771   0.713   3.929  1.00  0.00           C  
HETATM   22  C   UNL     1       3.832  -1.066   4.178  1.00  0.00           C  
HETATM   23  C   UNL     1       4.138   0.420   4.450  1.00  0.00           C  
HETATM   24  C   UNL     1       5.010  -1.707   3.369  1.00  0.00           C  
HETATM   25  C   UNL     1       7.102  -0.620   3.280  1.00  0.00           C  
HETATM   26  C   UNL     1       8.386  -0.387   4.084  1.00  0.00           C  
HETATM   27  C   UNL     1       9.428   0.367   3.245  1.00  0.00           C  
HETATM   28  C   UNL     1       9.604  -0.305   1.881  1.00  0.00           C  
HETATM   29  C   UNL     1       8.247  -0.488   1.202  1.00  0.00           C  
HETATM   30  C   UNL     1       8.391  -1.224  -0.123  1.00  0.00           C  
HETATM   31  C   UNL     1      11.688   1.176   3.155  1.00  0.00           C  
HETATM   32  C   UNL     1      11.210  -0.939   4.190  1.00  0.00           C  
HETATM   33  C   UNL     1       4.961  -3.250   3.103  1.00  0.00           C  
HETATM   34  C   UNL     1       6.237  -3.661   2.338  1.00  0.00           C  
HETATM   35  C   UNL     1       4.818  -4.055   4.425  1.00  0.00           C  
HETATM   36  C   UNL     1       4.868  -5.592   4.298  1.00  0.00           C  
HETATM   37  C   UNL     1       5.329  -6.239   5.606  1.00  0.00           C  
HETATM   38  C   UNL     1       3.538  -6.178   3.809  1.00  0.00           C  
HETATM   39  C   UNL     1       2.362  -6.292   4.794  1.00  0.00           C  
HETATM   40  C   UNL     1       1.106  -5.510   4.312  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.883  -6.738   4.131  1.00  0.00           C  
HETATM   42  C   UNL     1      -0.662  -3.793   5.027  1.00  0.00           C  
HETATM   43  C   UNL     1       0.083  -5.109   5.422  1.00  0.00           C  
HETATM   44  C   UNL     1       0.641  -5.027   6.846  1.00  0.00           C  
HETATM   45  C   UNL     1       3.942  -2.853   1.023  1.00  0.00           C  
HETATM   46  C   UNL     1       0.510  -6.572   2.056  1.00  0.00           C  
HETATM   47  C   UNL     1       0.599  -5.309   1.206  1.00  0.00           C  
HETATM   48  C   UNL     1       0.875  -5.612  -0.269  1.00  0.00           C  
HETATM   49  C   UNL     1       0.899  -4.329  -1.100  1.00  0.00           C  
HETATM   50  C   UNL     1       2.370  -4.643  -3.104  1.00  0.00           C  
HETATM   51  C   UNL     1       0.917  -5.020  -4.614  1.00  0.00           C  
HETATM   52  C   UNL     1       0.342  -5.304  -5.891  1.00  0.00           C  
HETATM   53  C   UNL     1       1.140  -5.482  -7.018  1.00  0.00           C  
HETATM   54  C   UNL     1       0.551  -5.756  -8.247  1.00  0.00           C  
HETATM   55  C   UNL     1      -0.831  -5.841  -8.300  1.00  0.00           C  
HETATM   56  C   UNL     1      -1.032  -5.410  -6.052  1.00  0.00           C  
HETATM   57  C   UNL     1       0.202  -4.831  -3.454  1.00  0.00           C  
HETATM   58  C   UNL     1       2.126  -7.769   5.113  1.00  0.00           C  
HETATM   59  C   UNL     1      -1.840  -3.441   5.938  1.00  0.00           C  
HETATM   60  C   UNL     1      -2.522  -2.182   5.468  1.00  0.00           C  
HETATM   61  C   UNL     1       2.440  -1.241   3.509  1.00  0.00           C  
HETATM   62  C   UNL     1       1.182  -0.882   1.551  1.00  0.00           C  
HETATM   63  C   UNL     1       0.501   0.457   1.249  1.00  0.00           C  
HETATM   64  C   UNL     1       1.195   1.225   0.110  1.00  0.00           C  
HETATM   65  C   UNL     1       2.291   2.591   1.675  1.00  0.00           C  
HETATM   66  C   UNL     1       0.372   2.459  -0.272  1.00  0.00           C  
HETATM   67  C   UNL     1       1.405   0.281  -1.091  1.00  0.00           C  
HETATM   68  C   UNL     1       2.074  -1.034  -0.666  1.00  0.00           C  
HETATM   69  C   UNL     1       2.164  -2.019  -1.828  1.00  0.00           C  
HETATM   70  H   UNL     1       7.395   1.034   4.954  1.00  0.00           H  
HETATM   71  H   UNL     1       2.843   1.464  -1.631  1.00  0.00           H  
HETATM   72  H   UNL     1       1.513  -0.646   5.402  1.00  0.00           H  
HETATM   73  H   UNL     1       0.634   1.346   4.812  1.00  0.00           H  
HETATM   74  H   UNL     1       1.501   1.195   3.271  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.183   0.651   3.398  1.00  0.00           H  
HETATM   76  H   UNL     1       3.801  -1.538   5.167  1.00  0.00           H  
HETATM   77  H   UNL     1       4.970   0.518   5.154  1.00  0.00           H  
HETATM   78  H   UNL     1       4.410   0.933   3.523  1.00  0.00           H  
HETATM   79  H   UNL     1       3.264   0.921   4.878  1.00  0.00           H  
HETATM   80  H   UNL     1       5.075  -1.191   2.403  1.00  0.00           H  
HETATM   81  H   UNL     1       6.566   0.318   3.096  1.00  0.00           H  
HETATM   82  H   UNL     1       8.788  -1.348   4.427  1.00  0.00           H  
HETATM   83  H   UNL     1       9.097   1.403   3.103  1.00  0.00           H  
HETATM   84  H   UNL     1      10.270   0.290   1.244  1.00  0.00           H  
HETATM   85  H   UNL     1      10.074  -1.288   2.019  1.00  0.00           H  
HETATM   86  H   UNL     1       7.775   0.482   1.009  1.00  0.00           H  
HETATM   87  H   UNL     1       8.843  -0.573  -0.877  1.00  0.00           H  
HETATM   88  H   UNL     1       9.026  -2.107  -0.005  1.00  0.00           H  
HETATM   89  H   UNL     1       7.414  -1.550  -0.490  1.00  0.00           H  
HETATM   90  H   UNL     1      11.217   2.071   2.739  1.00  0.00           H  
HETATM   91  H   UNL     1      12.073   0.567   2.333  1.00  0.00           H  
HETATM   92  H   UNL     1      12.527   1.482   3.787  1.00  0.00           H  
HETATM   93  H   UNL     1      10.991  -1.233   5.220  1.00  0.00           H  
HETATM   94  H   UNL     1      12.292  -0.981   4.035  1.00  0.00           H  
HETATM   95  H   UNL     1      10.730  -1.649   3.511  1.00  0.00           H  
HETATM   96  H   UNL     1       6.308  -3.120   1.390  1.00  0.00           H  
HETATM   97  H   UNL     1       7.129  -3.437   2.931  1.00  0.00           H  
HETATM   98  H   UNL     1       6.227  -4.734   2.123  1.00  0.00           H  
HETATM   99  H   UNL     1       3.868  -3.788   4.903  1.00  0.00           H  
HETATM  100  H   UNL     1       5.618  -3.741   5.108  1.00  0.00           H  
HETATM  101  H   UNL     1       5.624  -5.872   3.554  1.00  0.00           H  
HETATM  102  H   UNL     1       6.314  -6.697   5.482  1.00  0.00           H  
HETATM  103  H   UNL     1       5.394  -5.491   6.403  1.00  0.00           H  
HETATM  104  H   UNL     1       4.625  -7.016   5.920  1.00  0.00           H  
HETATM  105  H   UNL     1       2.714  -5.815   5.714  1.00  0.00           H  
HETATM  106  H   UNL     1       1.435  -4.623   3.759  1.00  0.00           H  
HETATM  107  H   UNL     1      -1.063  -3.901   4.012  1.00  0.00           H  
HETATM  108  H   UNL     1       1.619  -5.512   6.904  1.00  0.00           H  
HETATM  109  H   UNL     1       0.755  -3.983   7.155  1.00  0.00           H  
HETATM  110  H   UNL     1      -0.032  -5.523   7.552  1.00  0.00           H  
HETATM  111  H   UNL     1       4.675  -3.334   0.370  1.00  0.00           H  
HETATM  112  H   UNL     1       4.236  -1.818   1.218  1.00  0.00           H  
HETATM  113  H   UNL     1       2.962  -2.866   0.540  1.00  0.00           H  
HETATM  114  H   UNL     1      -0.301  -7.211   1.692  1.00  0.00           H  
HETATM  115  H   UNL     1       1.441  -7.146   2.015  1.00  0.00           H  
HETATM  116  H   UNL     1       1.385  -4.653   1.599  1.00  0.00           H  
HETATM  117  H   UNL     1      -0.349  -4.765   1.289  1.00  0.00           H  
HETATM  118  H   UNL     1       0.105  -6.291  -0.657  1.00  0.00           H  
HETATM  119  H   UNL     1       1.834  -6.134  -0.373  1.00  0.00           H  
HETATM  120  H   UNL     1       1.680  -3.646  -0.745  1.00  0.00           H  
HETATM  121  H   UNL     1      -0.056  -3.795  -1.025  1.00  0.00           H  
HETATM  122  H   UNL     1       3.294  -4.486  -2.564  1.00  0.00           H  
HETATM  123  H   UNL     1       2.223  -5.412  -6.950  1.00  0.00           H  
HETATM  124  H   UNL     1       1.155  -5.899  -9.136  1.00  0.00           H  
HETATM  125  H   UNL     1      -1.339  -6.052  -9.235  1.00  0.00           H  
HETATM  126  H   UNL     1      -1.712  -5.280  -5.214  1.00  0.00           H  
HETATM  127  H   UNL     1      -0.856  -4.845  -3.231  1.00  0.00           H  
HETATM  128  H   UNL     1       3.072  -8.319   5.107  1.00  0.00           H  
HETATM  129  H   UNL     1       1.669  -7.881   6.100  1.00  0.00           H  
HETATM  130  H   UNL     1       1.460  -8.220   4.371  1.00  0.00           H  
HETATM  131  H   UNL     1      -1.452  -3.320   6.944  1.00  0.00           H  
HETATM  132  H   UNL     1      -2.526  -4.282   5.925  1.00  0.00           H  
HETATM  133  H   UNL     1      -1.837  -1.328   5.472  1.00  0.00           H  
HETATM  134  H   UNL     1      -2.914  -2.291   4.452  1.00  0.00           H  
HETATM  135  H   UNL     1      -3.358  -1.953   6.136  1.00  0.00           H  
HETATM  136  H   UNL     1       2.272  -2.311   3.371  1.00  0.00           H  
HETATM  137  H   UNL     1       0.557  -1.451   2.247  1.00  0.00           H  
HETATM  138  H   UNL     1      -0.538   0.257   0.955  1.00  0.00           H  
HETATM  139  H   UNL     1       0.492   1.071   2.157  1.00  0.00           H  
HETATM  140  H   UNL     1       2.631   2.095   2.587  1.00  0.00           H  
HETATM  141  H   UNL     1       1.238   2.868   1.768  1.00  0.00           H  
HETATM  142  H   UNL     1       2.889   3.491   1.508  1.00  0.00           H  
HETATM  143  H   UNL     1       1.030   3.296  -0.525  1.00  0.00           H  
HETATM  144  H   UNL     1      -0.263   2.245  -1.137  1.00  0.00           H  
HETATM  145  H   UNL     1      -0.270   2.765   0.560  1.00  0.00           H  
HETATM  146  H   UNL     1       0.427   0.055  -1.534  1.00  0.00           H  
HETATM  147  H   UNL     1       3.097  -0.854  -0.315  1.00  0.00           H  
HETATM  148  H   UNL     1       2.487  -3.003  -1.474  1.00  0.00           H  
HETATM  149  H   UNL     1       1.190  -2.131  -2.314  1.00  0.00           H  
HETATM  150  H   UNL     1       2.883  -1.669  -2.575  1.00  0.00           H  
CONECT    1   29   25                                                 
CONECT    2   25   24                                                 
CONECT    3   26   70                                                 
CONECT    4   19   42                                                 
CONECT    5   19   19                                                 
CONECT    6   41   41                                                 
CONECT    7   41   43                                                 
CONECT    8   33   45                                                 
CONECT    9   38   38                                                 
CONECT   10   62   61                                                 
CONECT   11   65   64                                                 
CONECT   12   67   71                                                 
CONECT   13   68   62                                                 
CONECT   14   31   32   27                                            
CONECT   15   46   40   41                                            
CONECT   16   57   49   50                                            
CONECT   17   51   50   50                                            
CONECT   18   55   55   56                                            
CONECT   19    4    5    5   20                                       
CONECT   20   19   61   21   72                                       
CONECT   21   20   73   74   75                                       
CONECT   22   24   23   61   76                                       
CONECT   23   22   77   78   79                                       
CONECT   24    2   22   33   80                                       
CONECT   25    1    2   26   81                                       
CONECT   26    3   25   27   82                                       
CONECT   27   14   26   28   83                                       
CONECT   28   27   29   84   85                                       
CONECT   29    1   28   30   86                                       
CONECT   30   29   87   88   89                                       
CONECT   31   14   90   91   92                                       
CONECT   32   14   93   94   95                                       
CONECT   33    8   24   34   35                                       
CONECT   34   33   96   97   98                                       
CONECT   35   33   36   99  100                                       
CONECT   36   35   37   38  101                                       
CONECT   37   36  102  103  104                                       
CONECT   38    9    9   36   39                                       
CONECT   39   38   58   40  105                                       
CONECT   40   15   39   43  106                                       
CONECT   41    6    6    7   15                                       
CONECT   42    4   43   59  107                                       
CONECT   43    7   40   42   44                                       
CONECT   44   43  108  109  110                                       
CONECT   45    8  111  112  113                                       
CONECT   46   15   47  114  115                                       
CONECT   47   46   48  116  117                                       
CONECT   48   47   49  118  119                                       
CONECT   49   16   48  120  121                                       
CONECT   50   16   17   17  122                                       
CONECT   51   17   57   57   52                                       
CONECT   52   51   53   56   56                                       
CONECT   53   52   54   54  123                                       
CONECT   54   53   53   55  124                                       
CONECT   55   18   18   54  125                                       
CONECT   56   18   52   52  126                                       
CONECT   57   16   51   51  127                                       
CONECT   58   39  128  129  130                                       
CONECT   59   42   60  131  132                                       
CONECT   60   59  133  134  135                                       
CONECT   61   10   20   22  136                                       
CONECT   62   10   13   63  137                                       
CONECT   63   62   64  138  139                                       
CONECT   64   11   63   67   66                                       
CONECT   65   11  140  141  142                                       
CONECT   66   64  143  144  145                                       
CONECT   67   12   64   68  146                                       
CONECT   68   13   67   69  147                                       
CONECT   69   68  148  149  150                                       
CONECT   70    3                                                      
CONECT   71   12                                                      
CONECT   72   20                                                      
CONECT   73   21                                                      
CONECT   74   21                                                      
CONECT   75   21                                                      
CONECT   76   22                                                      
CONECT   77   23                                                      
CONECT   78   23                                                      
CONECT   79   23                                                      
CONECT   80   24                                                      
CONECT   81   25                                                      
CONECT   82   26                                                      
CONECT   83   27                                                      
CONECT   84   28                                                      
CONECT   85   28                                                      
CONECT   86   29                                                      
CONECT   87   30                                                      
CONECT   88   30                                                      
CONECT   89   30                                                      
CONECT   90   31                                                      
CONECT   91   31                                                      
CONECT   92   31                                                      
CONECT   93   32                                                      
CONECT   94   32                                                      
CONECT   95   32                                                      
CONECT   96   34                                                      
CONECT   97   34                                                      
CONECT   98   34                                                      
CONECT   99   35                                                      
CONECT  100   35                                                      
CONECT  101   36                                                      
CONECT  102   37                                                      
CONECT  103   37                                                      
CONECT  104   37                                                      
CONECT  105   39                                                      
CONECT  106   40                                                      
CONECT  107   42                                                      
CONECT  108   44                                                      
CONECT  109   44                                                      
CONECT  110   44                                                      
CONECT  111   45                                                      
CONECT  112   45                                                      
CONECT  113   45                                                      
CONECT  114   46                                                      
CONECT  115   46                                                      
CONECT  116   47                                                      
CONECT  117   47                                                      
CONECT  118   48                                                      
CONECT  119   48                                                      
CONECT  120   49                                                      
CONECT  121   49                                                      
CONECT  122   50                                                      
CONECT  123   53                                                      
CONECT  124   54                                                      
CONECT  125   55                                                      
CONECT  126   56                                                      
CONECT  127   57                                                      
CONECT  128   58                                                      
CONECT  129   58                                                      
CONECT  130   58                                                      
CONECT  131   59                                                      
CONECT  132   59                                                      
CONECT  133   60                                                      
CONECT  134   60                                                      
CONECT  135   60                                                      
CONECT  136   61                                                      
CONECT  137   62                                                      
CONECT  138   63                                                      
CONECT  139   63                                                      
CONECT  140   65                                                      
CONECT  141   65                                                      
CONECT  142   65                                                      
CONECT  143   66                                                      
CONECT  144   66                                                      
CONECT  145   66                                                      
CONECT  146   67                                                      
CONECT  147   68                                                      
CONECT  148   69                                                      
CONECT  149   69                                                      
CONECT  150   69                                                      
MASTER        0    0    0    0    0    0    0    0  150    0  150    0
END
